Thermodynamics Research Center / ThermoML | Journal of Chemical and Engineering Data

Solubility Measurement and Correlation of (+)-Biotin Intermediate Lactone in Different Organic Solvents from (287.15 to 323.75) K

Shi, Y.[Yunlong], Qian, C.[Chao], Chen, X.-Z.[Xin-Zhi]
J. Chem. Eng. Data 2016, 61, 4, 1509-1516
ABSTRACT
The solubilities of (+)-biotin intermediate lactone in methanol, toluene, tetrahydrofuran, dichloromethane, ethyl acetate, N,N-dimethylformamide were determined at the investigated temperature (287.15 to 323.75) K under pressure (p = 0.1 MPa) by a laser monitoring system. The solubilities of (+)-biotin intermediate lactone in pure solvents increase with increasing temperature and in the following order: methanol less than toluene less than ethyl acetate less than tetrahydrofuran less than dichloromethane less than N,N-dimethylformamide. The solubilities were correlated by the equation for ideal solution model, modified Apelblat equation, eh equation, Wilson model and NRTL equation. The calculated values are in good agreement with the measured experimental data. The modified Apelblat equation was found to provide further accurate representation of the experimental data in six organic solvents.
Compounds
# Formula Name
1 C19H18N2O3 (3aS,6aR)-1,3-dibenzyltetrahydro-1H-furo[3,4-d]imidazole-2,4-dione
2 CH4O methanol
3 C7H8 toluene
4 C4H8O2 ethyl acetate
5 C4H8O tetrahydrofuran
6 CH2Cl2 dichloromethane
7 C3H7NO dimethylformamide
Datasets
The table above is generated from the ThermoML associated json file (link above). POMD and RXND refer to PureOrMixture and Reaction Datasets. The compound numbers are included in properties, variables, and phases, if specificied; the numbers refer to the table of compounds on the left.
Type Compound-# Property Variable Constraint Phase Method #Points
  • POMD
  • 1
  • Normal melting temperature, K ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • DTA
  • 1
  • POMD
  • 1
  • Molar enthalpy of transition or fusion, kJ/mol ; Crystal
  • Crystal
  • Liquid
  • Air at 1 atmosphere
  • DSC
  • 1
  • POMD
  • 2
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Titration method
  • 7
  • POMD
  • 3
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Titration method
  • 7
  • POMD
  • 4
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Titration method
  • 7
  • POMD
  • 5
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Titration method
  • 7
  • POMD
  • 6
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Titration method
  • 7
  • POMD
  • 7
  • 1
  • Mole fraction - 1 ; Liquid
  • Temperature, K; Liquid
  • Pressure, kPa; Liquid
  • Liquid
  • Crystal - 1
  • Titration method
  • 7